%chk=000299109.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299109

0 1
O 4.455185 0.813482 -1.378341
O 4.646017 -1.181349 2.070365
N 0.017521 0.007767 -0.321300
N 0.115811 -1.297638 -0.811609
N -1.031396 -1.865999 -0.850168
N -1.929602 1.377157 0.481724
N -4.062098 0.085210 0.329621
N -4.156176 -2.130699 -0.464683
N -4.011773 2.320050 1.061778
C 3.206130 -0.436674 0.246987
C 1.177136 0.921788 -0.127142
C 2.123039 0.386648 0.970382
C 3.230063 0.072281 -1.217335
C 2.024639 1.014728 -1.410663
C 4.585680 -0.340380 0.909981
C -1.326727 0.263536 -0.020502
C -2.003788 -0.965731 -0.371510
C -3.415647 -1.017130 -0.174000
C -3.305815 1.223234 0.616777
H 2.894961 -1.513290 0.237623
H 0.748475 1.919858 0.155432
H 1.588772 -0.219803 1.721565
H 2.566798 1.239905 1.516565
H 3.231406 -0.765376 -1.943846
H 1.444817 0.759339 -2.314211
H 2.378624 2.054364 -1.551660
H 4.853832 0.694084 1.184197
H 5.381042 -0.756429 0.259622
H 4.607995 1.028931 -2.315913
H 3.999628 -0.891768 2.740504
H -5.153331 -2.143451 -0.315362
H -3.710859 -2.959487 -0.829165
H -3.518697 3.137402 1.385863
H -4.993261 2.233538 1.275324


%chk=000299109-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000299109

0 1
O 4.591470 0.590008 -1.357148
O 3.993611 -1.082433 2.432246
N 0.037926 0.182574 -0.555637
N 0.204567 -1.071607 -1.237566
N -0.977765 -1.712747 -1.198924
N -1.838379 1.316614 0.596973
N -3.895265 -0.071455 0.520739
N -3.972576 -2.184813 -0.517642
N -3.857630 2.018247 1.555576
C 2.990910 -0.373369 0.261812
C 1.160375 1.125271 -0.379125
C 2.060633 0.733623 0.825936
C 3.228883 0.020556 -1.229577
C 2.138833 1.081551 -1.580293
C 4.282981 -0.585994 1.071539
C -1.256215 0.298157 -0.094359
C -1.887149 -0.907153 -0.511268
C -3.269364 -1.064281 -0.169086
C -3.162719 1.054387 0.864418
H 2.432680 -1.327854 0.265000
H 0.692558 2.115854 -0.242134
H 1.462425 0.411050 1.695645
H 2.653975 1.623480 1.118312
H 3.138120 -0.872222 -1.876558
H 1.620208 0.875482 -2.530729
H 2.638340 2.065538 -1.650352
H 4.881074 0.345229 1.104009
H 4.901669 -1.374834 0.616150
H 4.812146 0.670607 -2.318585
H 3.532726 -0.368196 2.940834
H -4.952528 -2.258064 -0.252474
H -3.512082 -2.934531 -1.029398
H -3.378445 2.868908 1.836843
H -4.837596 1.860516 1.771726


